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  1. 3381
    “…The previously investigated La(3+)-hydrate has been re-evaluated by means of the quantum mechanical charge field (QMCF) molecular dynamics (MD) approach. …”
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    Hydration of trivalent lanthanum revisited – An ab initio QMCF-MD approach
  2. 3382
    “…To prepare the optimal atomic coordinates of dataset molecules, pairwise 3D structural alignments were carried out in order for the quantum mechanical cross correlation between the template and other molecules to be maximized. …”
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    Derivation of Highly Predictive 3D-QSAR Models for hERG Channel Blockers Based on the Quantum Artificial Neural Network Algorithm
  3. 3383
    “…Recently, increasing attention has been paid to quantum mechanical behavior in biology. In this study, we investigated the involvement of quantum mechanical tunneling in the hydrogen-transfer reaction from Trolox, a water-soluble analog of vitamin E (α-tocopherol), to 2,2-diphenyl-1-picrylhydrazyl radical (DPPH(•)) in a phosphate buffer solution (0.05 M, pH 7.0). …”
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    Tunneling in the Hydrogen-Transfer Reaction from a Vitamin E Analog to an Inclusion Complex of 2,2-Diphenyl-1-picrylhydrazyl Radical with β-Cyclodextrin in an Aqueous Buffer Solution at Ambient Temperature
  4. 3384
    por Pauli, Wolfgang
    Publicado 2001
    “…Pauli writes about mathematical contributions to the quantum-mechanical calculus.…”
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    Pauli letter collection: letter to Werner Heisenberg
  5. 3385
    por Giovannini, Massimo
    Publicado 2022
    “…The large-scale magnetic fields arising from the quantum mechanical fluctuations of the hypercharge are investigated when the evolution of the gauge coupling is combined with a sufficiently long inflationary stage. …”
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    The scaling of primordial gauge fields
  6. 3386
    “…The structural data from the simulation compared well with the quantum mechanical structure and the system density compared well with experimental values. …”
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    ForceGen: atomic covalent bond value derivation for Gromacs
  7. 3387
    por Pauli, Wolfgang
    Publicado 2000
    “…Pauli makes a short remark on the application of quantum-mechanical formalism to classical theories.…”
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    Pauli letter collection: letter to Paul A M Dirac
  8. 3388
    por Bakas, Ioannis, Park, Q-Han
    Publicado 1996
    “…These models, however, do not provide quantum mechanically consistent string backgrounds in the case the underlying WZW constraints are first solved classically.…”
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    Gravitational dressing of massive soliton theories
  9. 3389
    “…Confinement in different trap geometries, the influence of trap imperfections, classical and quantum mechanical description of the trapped particle motion, different methods of ion cooling to low temperatures, and non-neutral plasma properties (including Coulomb crystals) are the main subjects. …”
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    Charged particle traps: physics and techniques of charged particle field confinement
  10. 3390
    por Cinar, Zekiye
    Publicado 2017
    “…Since quantum mechanical methods utilize the principles of particle physics, their use may be extended to the design of new photocatalysts. …”
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    The Role of Molecular Modeling in TiO(2) Photocatalysis
  11. 3391
    por Wager, John F., Keszler, Douglas A.
    Publicado 2023
    “…[Image: see text] Quantum mechanical electron tunneling is proposed as the mediator of chemical bonding. …”
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    Bonding and Tunneling
  12. 3392
    “…We also discuss how accurate polarizable force fields for biphenylic anions can be constructed from quantum-mechanical reference data.…”
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    Enantiomerization of Axially Chiral Biphenyls: Polarizable MD Simulations in Water and Butylmethylether
  13. 3393
    por Brax, P., Davis, A.C.
    Publicado 2001
    “…These naked singularities are either time-like or null, corresponding to the finite or infinite amount of conformal time that massless particles take in order to reach them. Quantum mechanically we show that the brane-world naked singularities are inconsistent. …”
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    On Brane Cosmology and Naked Singularities
  14. 3394
    por Pauli, Wolfgang
    Publicado 2000
    “…Pauli describes his latest work in quantum mechanic and compares it with Heisenberg's work. …”
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    Pauli letter collection: letter to Niels Bohr
  15. 3395
    “…The high cohesive energy indicates structural stability, and the quantum-mechanical descriptors show a high polarity and low chemical reactivity. …”
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    Understanding of the Effect of the Adsorption of Atom and Cluster Silver on Chitosan: An In Silico Analysis
  16. 3396
    “…Here, we discuss recent progress in the development of carbon-nanotube-based devices for quantum technology, i.e., quantum mechanical strategies for revolutionizing computation, sensing, and communication. …”
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    Carbon Nanotube Devices for Quantum Technology
  17. 3397
    por Siegman, Anthony E
    Publicado 1986
    “…An introductory text on laser physics features an emphasis on basic laser principles and theory, without requiring a quantum mechanical background.…”
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    Lasers
  18. 3398
    por Moruzzi, Giovanni, Strumia, Franco
    Publicado 1991
    “…In retrospect to Hanle's discovery of quantum mechanical coherence between two quantum states about 65 years ago, this book demonstrates the enormous impact and central importance the effect has had, and most vividly still has, on modern physics. …”
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    The Hanle effect and level-crossing spectroscopy
  19. 3399
    “…We also show the possibility of carrying out diverse research into chromotherapy that is pertinent to deciphering the quantum mechanical dipole moment of water molecules. The quantum mechanical dipole moment as a result of the absorption of different colors, we conjecture, produces charge quantization phenomena. …”
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    A Critical Analysis of Chromotherapy and Its Scientific Evolution
  20. 3400
    “…Furthermore, we illustrate that quantum mechanical scattering calculations can be used to determine the orientation of the in- and outgoing beam with respect to the stepped surface structure.…”
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    Online Artículo Texto
    Surface electronic corrugation of a one-dimensional topological metal: Bi(114)
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